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Substance Name: Verlukast sodium
RN: 162377-77-7
UNII: Q8W8588793
InChIKey: XNAYQOBPAXEYLI-LQKFMROPSA-M

Molecular Formula

  • C26-H26-Cl-N2-O3-S2.Na

Molecular Weight

  • 537.0774
 
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Names and Synonyms

Name of Substance

  • Verlukast sodium

Synonyms

  • 5-(3-(2-(7-Chloroquinolin-2-yl)ethenyl)phenyl)-8-dimethylcarbamyl-4,6-dithiaoctanoic acid sodium salt
  • MK-0679 sodium salt
  • Propanoic acid, 3-(((3-(2-(7-chloro-2-quinolinyl)ethenyl)phenyl)((3-(dimethylamino)-3-oxopropyl)thio)methyl)thio)-, sodium salt, (R-(E))-
  • UNII-Q8W8588793
  • Verlukast sodium

Registry Numbers

CAS Registry Number

  • 162377-77-7

FDA UNII

  • Q8W8588793

System Generated Number

  • 0162377777

Structure Descriptors

InChI

1S/C26H27ClN2O3S2.Na/c1-29(2)24(30)12-14-33-26(34-15-13-25(31)32)20-5-3-4-18(16-20)6-10-22-11-8-19-7-9-21(27)17-23(19)28-22;/h3-11,16-17,26H,12-15H2,1-2H3,(H,31,32);/q;+1/p-1/b10-6+;/t26-;/m1./s1

InChIKey

XNAYQOBPAXEYLI-LQKFMROPSA-M

Smiles

CN(C)C(=O)CCS[C@@H](c1cccc(c1)/C=C/c2ccc3ccc(cc3n2)Cl)SCCC(=O)[O-].[Na+]